3-ISORESERPILINE MESYLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H28N2O5.CH4O3S
Molecular Weight	508.584
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CS(O)(=O)=O.COC(=O)C1=CO[C@@H](C)[C@@H]2CN3CCC4=C(NC5=C4C=C(OC)C(OC)=C5)[C@@H]3C[C@H]12

InChI

InChIKey=YVQIWEXIIFSNNQ-DEIYWNCWSA-N

InChI=1S/C23H28N2O5.CH4O3S/c1-12-16-10-25-6-5-13-15-8-20(27-2)21(28-3)9-18(15)24-22(13)19(25)7-14(16)17(11-30-12)23(26)29-4;1-5(2,3)4/h8-9,11-12,14,16,19,24H,5-7,10H2,1-4H3;1H3,(H,2,3,4)/t12-,14-,16-,19-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C23H28N2O5
Molecular Weight	412.4788
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	CH4O3S
Molecular Weight	96.106
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:49:24 GMT 2025` Edited by `admin` on `Mon Mar 31 20:49:24 GMT 2025`
Record UNII	E90E0F872X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISORESERPILINE, METHANESULFONATE

Preferred Name

English

3-ISORESERPILINE MESYLATE

Common Name

English

Code System Code Type Description

CAS

117020-41-4

Created by admin on Mon Mar 31 20:49:24 GMT 2025 , Edited by admin on Mon Mar 31 20:49:24 GMT 2025

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FDA UNII

E90E0F872X

Created by admin on Mon Mar 31 20:49:24 GMT 2025 , Edited by admin on Mon Mar 31 20:49:24 GMT 2025

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PUBCHEM

90478802

Created by admin on Mon Mar 31 20:49:24 GMT 2025 , Edited by admin on Mon Mar 31 20:49:24 GMT 2025

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